engelberger Goto Github PK

evoprotgrad

Directed evolution of proteins in sequence space with gradients

flow-matching

Investigating flow matching for protein design.

foldflow

Code release for our recent paper "SE(3)-Stochastic Flow Matching for Protein Backbone Generation" https://arxiv.org/abs/2310.02391

fragfold

frame2seq

Structure-conditioned masked language modeling for protein sequence design

framedipt

FrameDiPT: an SE(3) diffusion model for protein structure inpainting

frustraevo

frustrapy

gaunt-tensor-product

[ICLR 2024 Spotlight] Official Implementation of "Enabling Efficient Equivariant Operations in the Fourier Basis via Gaunt Tensor Products"

gomena.github.io

gomena.github.io

graph-neural-pde

Graph Neural PDEs

heme_binder_diffusion

icrofilexperiments

infgcn-pytorch

Official implementation of the NeurIPS 23 spotlight paper of ♾️InfGCN♾️.

intro-ai-pd

k-rcps

kin

Repo for the publication titled: "Key Interaction Networks: Identifying Evolutionarily Conserved Non-Covalent Interaction Networks Across Protein Families".

lecture2

lecture 2 - 2024-01-20

lida

Automatic Generation of Visualizations and Infographics using Large Language Models

lieneurons

Adjoint-Equivariant Neural Network for Semi-Simple Lie Algebras

liganddiff

LigandDiff

ligandmpnn

ligand_mpnn_jax

an ongoing attempt to port the pytorch ligand MPNN code to jax

linear_rep_geometry

live-typescript-monorepo

Strategies for live-updating TypeScript types in monorepos

llmcompiler

LLMCompiler: An LLM Compiler for Parallel Function Calling

localcolabfold

ColabFold on your local PC

logit-gfn

Official Code for Learning to Scale Logits for Temperature-conditional GFlowNets (ICML 2024)

ltt

Learn then Test: Calibrating Predictive Algorithms to Achieve Risk Control

ludwig

Low-code framework for building custom LLMs, neural networks, and other AI models